Compound Identification
SMILES
OC(=O)C1=C(CC[C@@H]2[C@H](N3[C@H](COC3=O)C3=CC=CC=C3)C(=O)N12)OS(=O)(=O)C(F)(F)F
InChIKey
InChIKey=FZGYFUZIPWBSCA-WZRBSPASSA-N
Formula
C18H15F3N2O8S
Mass
476.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
- Level 5 Carbacephems
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Subclass
Beta lactams
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Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Not available
Direct Parent
Carbacephems
Alternative Parents
Alpha amino acids and derivatives Trifluoromethanesulfonates Tetrahydropyridines Benzene and substituted derivatives Organosulfonic acid esters Sulfonic acid esters Oxazolidinones Tertiary carboxylic acid amides Carbamate esters Methanesulfonates Sulfonyls Trihalomethanes Azetidines Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Carbacephem - Alpha-amino acid or derivatives - Trifluoromethanesulfonate - Tetrahydropyridine - Monocyclic benzene moiety - Oxazolidinone - Sulfonic acid ester - Organosulfonic acid ester - Benzenoid - Carbamic acid ester - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Oxazolidine - Methanesulfonate - Azetidine - Trihalomethane - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Alkyl halide - Carbonyl group - Organic oxygen compound - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Halomethane - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as carbacephems. These are a new class of beta-lactam antibiotics similar in structure to the cephalosporins. They differ from cephalosporins, however, in the substitution of a sulfur atom in the dihydrothiazine ring with a methylene group to form a tetrahydropyridine ring.
External Descriptors
Not available